ethyl 5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
ethyl 5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | 8019-8551 |
| Compound Name: | ethyl 5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 416.22 |
| Molecular Formula: | C16 H18 Br N O7 |
| Smiles: | CCOC(C1CC(Cc2c(c3c(c(c2[Br])OC)OCO3)OC)ON=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3647 |
| logD: | 3.3647 |
| logSw: | -3.297 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.746 |
| InChI Key: | QMHZRDQNIPJMLG-QMMMGPOBSA-N |